SCHEMBL25009847

SCHEMBL25009847

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCC[C@@H](C)N

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.37
EPHX2 P34913 2/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GLP1R P43220 5/20 0.36
CASP2 P42575 1/20 0.36
TP53 P04637 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23729451 0.88 TSHR (0.51) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL27115230 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL29221102 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL26297961 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL17346257 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL21738833 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL26297950 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL24229748 0.86 OTC (0.49) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL31746997 0.86 GLP1R (0.37) TSHRKDM4ELMNAHPGDALDH1A1
SCHEMBL25009846 0.85 TSHR (0.45) TSHRKDM4ELMNAHPGDMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230038373-A1 STABILE CONJUGATE GLYKOS BIOMEDICAL OY (FI) 2023-02-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230038373-A1 STABILE CONJUGATE CD2, TTL, DDOST TSHR 1371/4885KDM4E 3642/4885LMNA 1344/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.